| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 7962171 | Computational Materials Science | 2012 | 9 Pages |
Abstract
⺠Binding and deformation energy contributions should be separated. ⺠AIM theory provide new insights for describing the interactions. ⺠Formaldehyde chemisorbs onto Al-doped and N-vacancy defected h-BN sheet. ⺠N-vacancy defected h-BN sheet show great sensitivity to formaldehyde. ⺠Formaldehyde monitoring is possible using N-vacancy defected h-BN.
Related Topics
Physical Sciences and Engineering
Engineering
Computational Mechanics
Authors
Siamak Noorizadeh, Ehsan Shakerzadeh,